REAL300013477299.mol2 41 1 C 0.03 0.30 11.01 101.05 1.11 1.41 16 2 O -0.37 -4.66 9.49 -42.94 -0.41 -5.07 16 3 C 0.04 0.42 6.28 37.15 0.23 0.66 16 4 C 0.13 1.49 5.86 -4.05 -0.02 1.47 16 5 N -0.61 -8.06 2.46 -179.42 -0.44 -8.50 16 6 C 0.13 1.98 4.51 -4.04 -0.02 1.96 16 7 C -0.20 -4.04 6.10 -27.88 -0.17 -4.21 16 8 C 0.49 14.03 8.05 36.01 0.29 14.32 16 9 O -0.70 -21.30 16.88 -20.22 -0.34 -21.64 16 10 O -0.70 -22.95 18.00 -20.23 -0.36 -23.31 16 11 C 0.71 9.33 7.65 -86.92 -0.66 8.66 16 12 O -0.56 -8.21 12.81 -2.43 -0.03 -8.24 16 13 N -0.68 -7.27 5.22 -14.22 -0.07 -7.34 16 14 C 0.21 1.88 6.28 -83.69 -0.53 1.36 16 15 C -0.11 -0.69 9.96 -39.40 -0.39 -1.08 16 16 C -0.08 -0.64 8.61 -39.61 -0.34 -0.98 16 17 C 0.34 3.64 4.82 -39.55 -0.19 3.45 16 18 F -0.15 -2.92 16.66 2.25 0.04 -2.89 16 19 F -0.16 -2.71 15.31 2.25 0.03 -2.68 16 20 F -0.17 -2.83 15.30 2.25 0.03 -2.80 16 21 F -0.17 -2.74 15.31 2.25 0.03 -2.70 16 22 F -0.17 -2.77 15.30 2.25 0.03 -2.74 16 23 C -0.08 -0.75 8.61 -39.61 -0.34 -1.09 16 24 C -0.08 -0.68 8.66 -39.39 -0.34 -1.02 16 25 H 0.04 0.32 8.14 -51.93 -0.42 -0.10 16 26 H 0.08 0.72 8.14 -51.93 -0.42 0.29 16 27 H 0.04 0.29 8.14 -51.93 -0.42 -0.13 16 28 H 0.05 0.55 8.14 -51.93 -0.42 0.13 16 29 H 0.06 0.48 8.14 -51.93 -0.42 0.06 16 30 H 0.10 0.96 8.07 -51.93 -0.42 0.54 16 31 H 0.09 1.09 7.42 -51.93 -0.39 0.71 16 32 H 0.07 1.13 6.25 -51.93 -0.32 0.80 16 33 H 0.09 1.43 8.03 -51.92 -0.42 1.01 16 34 H 0.07 1.26 8.14 -51.93 -0.42 0.84 16 35 H 0.06 1.14 8.14 -51.93 -0.42 0.71 16 36 H 0.42 4.34 6.51 -40.82 -0.27 4.07 16 37 H 0.18 0.68 8.06 -52.49 -0.42 0.25 16 38 H 0.18 1.21 7.39 -52.49 -0.39 0.82 16 39 H 0.18 1.46 7.39 -52.49 -0.39 1.07 16 40 H 0.19 1.75 6.40 -52.48 -0.34 1.42 16 Total: -1.00 -41.35 361.65 -3.71 -45.06